Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 9/20 | 0.57 |
| ▸ | NOS3 | P29474 | 1/20 | 0.48 |
| ▸ | NOS1 | P29475 | 1/20 | 0.48 |
| ▸ | NOS2 | P35228 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | PAM | P19021 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7081788 | 0.92 | IDO1 (0.61) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6831249 | 0.85 | IDO1 (0.54) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6684071 | 0.83 | IDO1 (0.53) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6685563 | 0.82 | IDO1 (0.51) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6685212 | 0.82 | IDO1 (0.51) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6683462 | 0.80 | IDO1 (0.50) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6684101 | 0.79 | IDO1 (0.49) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL1722103 | 0.78 | IDO1 (0.65) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL6827579 | 0.78 | IDO1 (0.48) | IDO1NOS3NOS1NOS2TDP1 | |
| SCHEMBL19473645 | 0.77 | IDO1 (0.63) | IDO1NOS3NOS1NOS2L3MBTL1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004065305-A1 | NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE | UNIVERSITY OF DAYTON (US) | 2004-08-05 | — | — | WO | disclosed |